N'-Nitrosonornicotine-N-beta-D-Glucuronide
[CAS# 864071-82-9]

Identification

• Name: N'-Nitrosonornicotine-N-beta-D-Glucuronide
• Synonyms: 1-(β-D-Glucopyranosyluronosyl)-3-[(2S)-1-nitroso-2-pyrrolidinyl]pyridinium; 1-(β-D-Glucopyranosyluronosyl)-3-[(2S)-1-nitroso-2-pyrrolidinyl]pyridinium; 1-(β-D-Glucopyranosyluronosyl)-3-[(2S)-1-nitroso-2-pyrrolidinyl]pyridinium
• Molecular Formula: C₁₅H₁₉N₃O₇
• Molecular Weight: 353.33
• CAS Registry Number: 864071-82-9
• SMILES: c1cc(c[n+](c1)[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)[O-])O)O)O)[C@@H]3CCCN3N=O
• InChI: 1S/C15H19N3O7/c19-10-11(20)13(15(22)23)25-14(12(10)21)17-5-1-3-8(7-17)9-4-2-6-18(9)16-24/h1,3,5,7,9-14,19-21H,2,4,6H2/t9-,10-,11-,12+,13-,14+/m0/s1
• InChIKey: PSNAJRIZSDTBSS-ARFNZGECSA-N

Properties

• Refractive index: (Cal.)